1,4-Dibromo benzene

• CAS: 106-37-6
• Catalog Number: ACM106376
• Category: Bromine Series
• Molecular Weight: 235.9g/mol
• Molecular Formula: C6H4Br2
• IUPAC Name: 1,4-dibromobenzene
• Canonical SMILES: C1=CC(=CC=C1Br)Br
• InChI: InChI=1S/C6H4Br2/c7-5-1-2-6(8)4-3-5/h1-4H
• InChI Key: SWJPEBQEEAHIGZ-UHFFFAOYSA-N
• Boiling Point: 218.5 °C;220.40 °C
• Melting Point: 87.3 °C;87.3 °C
• Density: 0.9641 @ 99.6 °C
• Solubility: 8.48e-05 M;SOLUBLE IN TOLUENE, VERY SOL IN HOT TOLUENE; VERY SOLUBLE IN CARBON DISULFIDE;Pratically insoluble in water; sol in about 70 parts alcohol; sol in benzene, chloroform; very sol in ether;> 10% in acetone;> 10% in benzene;> 10% in ether;> 10% in ethanol;Solubiliy in water = 20 mg/l at 25 °C;Insoluble in water; soluble in ethanol; very soluble in ethyl ether, acetone.
• Color/Form: PLATES;COLORLESS CRYSTALS
• Complexity: 54.9
• Covalently-Bonded Unit Count: 1
• Decomposition: MODERATELY DANGEROUS; WHEN HEATED TO DECOMPOSITION, IT EMITS TOXIC FUMES OF /HYDROGEN BROMIDE/.
• EC Number: 203-390-2
• Exact Mass: 235.86593g/mol
• Formal Charge: 0
• Hazard Statements: H226-H332
• H-Bond Acceptor: 0
• H-Bond Donor: 0
• Heat of Vaporization: 13,047.8 g cal/g mole
• Heavy Atom Count: 8
• LogP: 3.79 (LogP);Log Kow= 3.79
• Monoisotopic Mass: 233.86798g/mol
• NSC Number: 33942
• Odor: ODOR OF XYLENE
• Other Experimental: Dielectric constant: 7.77 at 10 °C; 6.7 at 40 °C; dipole moment: 1.43 (gas), 1.85 in liquid at 20 °C;Heat of fusion: 20.55 cal/g= 85.98 J/g= 20,284 J/mol;IR: 4276 (Coblentz Society Spectral Collection) /o-Dibromobenzene/;UV: 5-46 (Organic Electronic Spectral Data, Phillips et al, John Wiley & Sons, New York) /o-Dibromobenzene/;NMR: 11724 (Sadtler Research Laboratories Spectral Collection) /o-Dibromobenzene/;MASS: 1651 (Atlas of Mass Spectral Data, John Wiley & Sons, New York) /o-Dibromobenzene/;IR: 6879 (Coblentz Society Spectral Collection) /m-Dibromobenzene/;NMR: 18683 (Sadtler Research Laboratories Spectral Collection) /m-Dibromobenzene/;MASS: 264 (National Bureau of Standards EPA-NIH Mass Spectra Data Base, NSRDS-NBS-63) /m-Dibromobenzene/
• Refractive Index: INDEX OF REFRACTION: 1.5743 @ 99.3 °C/D
• RIDADR: UN 1993BF 3 / PGII
• Rotatable Bond Count: 0
• Symbol: GHS02
• UNII: 9991W3M5HZ
• Vapor Density: 8.1 (Air= 1)
• Vapor Pressure: 0.06 mmHg;0.0575 mm Hg @ 25 °C
• XLogP3: 3.8

Custom Q&A

What is the molecular formula of 1,4-Dibromobenzene?

The molecular formula of 1,4-Dibromobenzene is C6H4Br2.

What is the molecular weight of 1,4-Dibromobenzene?

The molecular weight of 1,4-Dibromobenzene is 235.90 g/mol.

What is the IUPAC name of 1,4-Dibromobenzene?

The IUPAC name of 1,4-Dibromobenzene is 1,4-dibromobenzene.

What is the InChI of 1,4-Dibromobenzene?

The InChI of 1,4-Dibromobenzene is InChI=1S/C6H4Br2/c7-5-1-2-6(8)4-3-5/h1-4H.

What is the InChIKey of 1,4-Dibromobenzene?

The InChIKey of 1,4-Dibromobenzene is SWJPEBQEEAHIGZ-UHFFFAOYSA-N.

What is the canonical SMILES of 1,4-Dibromobenzene?

The canonical SMILES of 1,4-Dibromobenzene is C1=CC(=CC=C1Br)Br.

What is the CAS number of 1,4-Dibromobenzene?

The CAS number of 1,4-Dibromobenzene is 106-37-6.

What is the EC number of 1,4-Dibromobenzene?

The EC number of 1,4-Dibromobenzene is 203-390-2.

What is the ChEMBL ID of 1,4-Dibromobenzene?

The ChEMBL ID of 1,4-Dibromobenzene is CHEMBL195407.

What is the Wikipedia page for 1,4-Dibromobenzene?

The Wikipedia page for 1,4-Dibromobenzene is "1,4-Dibromobenzene."